4-fluoro-1-methoxy-2-propoxybenzene

C10H13FO2 — CID 126738516

IUPAC4-fluoro-1-methoxy-2-propoxybenzene
SMILESCCCOc1cc(F)ccc1OC
InChIInChI=1S/C10H13FO2/c1-3-6-13-10-7-8(11)4-5-9(10)12-2/h4-5,7H,3,6H2,1-2H3
InChIKeySPFNSGPAECOROW-UHFFFAOYSA-N
MW184.21 g/mol
LogP2.62
Rot. Bonds4

About 4-fluoro-1-methoxy-2-propoxybenzene

4-fluoro-1-methoxy-2-propoxybenzene (PubChem CID 126738516) has the molecular formula C10H13FO2 and a molecular weight of 184.21 g/mol. Its IUPAC name is 4-fluoro-1-methoxy-2-propoxybenzene.

Molecular Properties

Compound Name4-fluoro-1-methoxy-2-propoxybenzene
PubChem CID126738516
Molecular FormulaC10H13FO2
Molecular Weight184.21 g/mol
Exact Mass184.09
IUPAC Name4-fluoro-1-methoxy-2-propoxybenzene
SMILESCCCOc1cc(F)ccc1OC
InChIInChI=1S/C10H13FO2/c1-3-6-13-10-7-8(11)4-5-9(10)12-2/h4-5,7H,3,6H2,1-2H3
InChIKeySPFNSGPAECOROW-UHFFFAOYSA-N
XLogP2.62
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.21
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(5-fluoro-2-methoxyphenoxy)propan-1-amine
CID 15034471
CID 174591366
CID 174591366
5-fluoro-2-propoxybenzenecarbothioamide
CID 63673082
1-(5-fluoro-2-propoxyphenyl)propan-2-amine
CID 103694484
4-fluoro-2-propoxybenzaldehyde
CID 74889364
1-(4-methoxy-3-propoxyphenyl)-N-methylmethanamine
CID 15079025
2-(4-fluorophenyl)-3-(4-methoxy-3-propoxyphenyl)propanoic acid
CID 82160495
1-(5-fluoro-2-propoxyphenyl)butan-2-amine;hydrochloride
CID 170890525
1-(5-fluoro-2-propoxyphenyl)propan-1-one
CID 82268324
(2R)-2-[(5-fluoro-2-methoxyphenoxy)methyl]pyrrolidine
CID 67315733
1-(5-fluoro-2-propoxyphenyl)heptane-3,4-diol
CID 83944242
propan-2-yl 2-(5-fluoro-2-propoxyphenyl)acetate
CID 82551406

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1-methoxy-2-propoxybenzene?
The IUPAC name of 4-fluoro-1-methoxy-2-propoxybenzene (CID 126738516) is 4-fluoro-1-methoxy-2-propoxybenzene.
What is the SMILES notation for 4-fluoro-1-methoxy-2-propoxybenzene?
The canonical SMILES for 4-fluoro-1-methoxy-2-propoxybenzene is CCCOc1cc(F)ccc1OC.
What is the InChIKey of 4-fluoro-1-methoxy-2-propoxybenzene?
The InChIKey is SPFNSGPAECOROW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FO2/c1-3-6-13-10-7-8(11)4-5-9(10)12-2/h4-5,7H,3,6H2,1-2H3.
What are the key properties of 4-fluoro-1-methoxy-2-propoxybenzene?
4-fluoro-1-methoxy-2-propoxybenzene has a molecular weight of 184.21 g/mol, XLogP of 2.62, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-methoxy-2-propoxybenzene is sourced from PubChem (CID 126738516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).